SCHEMBL23808154

SCHEMBL23808154

CNC(=O)N1N=CCC1c1ccc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ RIPK1 Q13546 16/20 0.48
▸ MAPT P10636 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ ACHE P22303 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23808092 0.85 RIPK1 (0.65) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL23808151 0.84 RIPK1 (0.49) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL23808141 0.81 TERT (0.47) NPC1RAB9ARIPK1MEN1KMT2A
SCHEMBL23808156 0.76 RIPK1 (0.55) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL23808158 0.75 RIPK1 (0.68) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL23808090 0.70 RIPK1 (0.68) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL24351038 0.68 RIPK1 (0.70) RIPK1POLB
SCHEMBL23808123 0.68 ALDH1A1 (0.72) NPC1RAB9ARIPK1MAPTMEN1
SCHEMBL30175792 0.67 RAD51 (0.43) RIPK1ACHE
SCHEMBL23831022 0.67 RIPK1 (0.65) NPC1RAB9ARIPK1MAPTMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210284647-A1 N-(3-(IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR TREATING KINASE-RELATED DISEASES VORONOI CO., LTD (KR) 2021-09-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210284647-A1 N-(3-(IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYLPHENYL)-5-PHENYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR TREATING KINASE-RELATED DISEASES MYLK3, MINK1, PLK2 NPC1 4812/4885RAB9A 941/4885RIPK1 33/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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